3-butan-2-yl-2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-butan-2-yl-2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 2-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanyl-3-sec-butyl-quinazolin-4-one CAS Name: 3-butan-2-yl-2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-butan-2-yl-2-[2-(4-ethylphenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 2-[[2-(4-ethylphenyl)-2-keto-ethyl]thio]-3-sec-butyl-quinazolin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)CC

InChI

InChI=1S/C22H24N2O2S/c1-4-15(3)24-21(26)18-8-6-7-9-19(18)23-22(24)27-14-20(25)17-12-10-16(5-2)11-13-17/h6-13,15H,4-5,14H2,1-3H3